Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester
TL;DR: Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester (CAS 73747-24-7) is a chemical compound with molecular formula C13H14F3NO3 and molecular weight 289.0926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]butanoate
Also Known As: 4- butyricacidmethylester, Butyric acid, methyl ester, Methyl 4-(p-trifluoroacetamidophenyl)butyrate, Benzenebutanoic acid, methyl ester, BUTYRIC ACID, 4-(p-TRIFLUOROACETAMIDOPHENYL)-, METHYL ESTER
Technical Specifications
| Molecular Formula | C13H14F3NO3 |
| Molecular Weight | 289.0926 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 289.0926 Da |
| Heavy Atoms | 20 |
| Complexity | 336.0 |
| SMILES | COC(=O)CCCC1=CC=C(C=C1)NC(=O)C(F)(F)F |
| InChIKey | PTVYRPUPPYROIW-UHFFFAOYSA-N |
Chemical Property Profile of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester
Property Insights of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester?
The CAS number of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester is 73747-24-7.
What is the molecular formula of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester?
The molecular formula of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester is C13H14F3NO3.
What is the molecular weight of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester?
The molecular weight of Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester is 289.0926 g/mol.
Where can I buy Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester?
You can request a quote for Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Butyric acid, 4-(p-trifluoroacetamidophenyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.